ChemSpider 2D Image | 1-{[1-(Tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]methyl}-3-(2-thienyl)urea | C16H25N3OS2

1-{[1-(Tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]methyl}-3-(2-thienyl)urea

  • Molecular FormulaC16H25N3OS2
  • Average mass339.519 Da
  • Monoisotopic mass339.143890 Da
  • ChemSpider ID35011384

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-{[1-(Tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]methyl}-3-(2-thienyl)harnstoff [German] [ACD/IUPAC Name]
1-{[1-(Tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]methyl}-3-(2-thienyl)urea [ACD/IUPAC Name]
1-{[1-(Tétrahydro-2H-thiopyrane-4-yl)-4-pipéridinyl]méthyl}-3-(2-thiényl)urée [French] [ACD/IUPAC Name]
Urea, N-[[1-(tetrahydro-2H-thiopyran-4-yl)-4-piperidinyl]methyl]-N'-2-thienyl- [ACD/Index Name]
1-((1-(tetrahydro-2H-thiopyran-4-yl)piperidin-4-yl)methyl)-3-(thiophen-2-yl)urea
1-{[1-(thian-4-yl)piperidin-4-yl]methyl}-3-(thiophen-2-yl)urea
2034383-72-5 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 480.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 244.5±28.7 °C
Index of Refraction: 1.621
Molar Refractivity: 96.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.81
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 6.44
ACD/KOC (pH 7.4): 50.73
Polar Surface Area: 98 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 273.9±3.0 cm3

Click to predict properties on the Chemicalize site


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